20-Hydroxypregnan-3-Yl Sulfate
Properties
| Property | Value |
|---|---|
| Formula | C21H36O5S |
| IUPAC Name | [(3r,5r,8r,9s,10s,13s,14s,17s)-17-[(1s)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate |
| Molecular Mass | 400.573 g·mol−1 |
| Heat of Formation | -1169.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.98 ± 1.08 D |
| Volume | 482.44 Å 3 |
| Surface Area | 379.92 Å 2 |
| HOMO Energy | -10.02 ± 0.55 eV |
| LUMO Energy | 0.00 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZIVKBPVUJZDVBI-BERLURQNSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O |